[4-[(Z)-(3-hexyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 4-methylbenzoate

Systemtic Name: [4-[(Z)-(3-hexyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 4-methylbenzoate Openeye Name: [4-[(Z)-(3-hexyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-[(Z)-(3-hexyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]phenyl] ester IUPAC Name: [4-[(Z)-(3-hexyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-[(Z)-(3-hexyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]phenyl] ester Formula: C24H25NO3S2 MolecularWeight: 439.5902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C(=CC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C)SC1=S

Isomeric SMILES

CCCCCCN1C(=O)/C(=C/C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C)/SC1=S

InChI

InChI=1S/C24H25NO3S2/c1-3-4-5-6-15-25-22(26)21(30-24(25)29)16-18-9-13-20(14-10-18)28-23(27)19-11-7-17(2)8-12-19/h7-14,16H,3-6,15H2,1-2H3/b21-16-